SCHEMBL7987332

SCHEMBL7987332

O=S(=O)(c1ccccc1)c1ccccc1Cn1c2cc(O)c(O)cc2c2ccc(O)c(O)c21

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRC P12931 18/20 0.72
NOX4 Q9NPH5 1/20 0.72
PRKACA P17612 7/20 0.52
PRKACG P22612 7/20 0.52
PRKACB P22694 7/20 0.52
PTGDR2 Q9Y5Y4 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7981611 0.87 NOX4 (0.77) SRCNOX4PRKACAPRKACGPRKACB
SCHEMBL7987325 0.84 SRC (1.00) SRCNOX4PRKACAPRKACGPRKACB
SCHEMBL7981060 0.84 NOX4 (1.00) SRCNOX4PRKACAPRKACGPRKACB
SCHEMBL7981658 0.78 SRC (1.00) SRCPRKACAPRKACGPRKACB
SCHEMBL7983976 0.73 NOX4 (0.49) SRCNOX4PTGDR2
SCHEMBL7984100 0.71 SRC (1.00) SRCPRKACAPRKACGPRKACB
SCHEMBL7981604 0.71 SRC (1.00) SRCNOX4PRKACAPRKACGPRKACB
SCHEMBL7983706 0.69 SRC (1.00) SRCPRKACAPRKACGPRKACB
SCHEMBL7981378 0.69 SRC (1.00) SRCPRKACAPRKACGPRKACB
SCHEMBL7981609 0.68 SRC (1.00) SRCPRKACAPRKACGPRKACB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6194439-B1 ANTICANCER AGENT PFIZER INC. 2001-02-27 US disclosed
WO-1992021660-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER, INC. (US) 1992-12-10 WO disclosed